2alpha-hydroxy-ent-isokaurene (CHEBI:140188)

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ChEBI Name	*2α-hydroxy-ent-isokaurene*

ChEBI ID	CHEBI:140188

ChEBI ASCII Name	2alpha-hydroxy-ent-isokaurene

Definition	An ent-kaurane diterpenoid in which the ent-kaurane skeleton has a double bond at C-15 and carries an α-configured hydroxy group at C-2.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C20H32O

Net Charge

Average Mass

288.468

Monoisotopic Mass

288.24532

InChI

InChI=1S/C20H32O/c1-13-9-20-8-7-16-18(2,3)11-15(21)12-19(16,4)17(20)6-5-14(13)10-20/h9,14-17,21H,5-8,10-12H2,1-4H3/t14-,15+,16-,17+,19-,20-/m1/s1

InChIKey

KMRGROLDAASNIW-UELOQWINSA-N

SMILES

C1[C@]2([C@@]3(CC[C@H]4C(=C[C@]3(CC[C@@]2(C(C[C@@H]1O)(C)C)[H])C4)C)[H])C

Metabolite of Species	Details
Oryza sativa (NCBI:txid4530)	See: PubMed

Roles Classification
Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	2α-hydroxy-ent-isokaurene (CHEBI:140188) has role plant metabolite (CHEBI:76924) 2α-hydroxy-ent-isokaurene (CHEBI:140188) is a ent-kaurane diterpenoid (CHEBI:36760)

IUPAC Name

(2S,4aR,6aS,9R,11aS,11bR)-4,4,8,11b-tetramethyl-1,2,3,4,4a,5,6,9,10,11,11a,11b-dodecahydro-6a,9-methanocyclohepta[a]naphthalen-2-ol

Last Modified

26 February 2018